Bioactive Compounds
Drug-like bioactive compounds for CKD-related targets (i.e., therapeutic targets in CKDdb) are extracted from ChEMBL. Detailed information and structure for each compound are provided, along with knowledge graphs linked with related therapeutic targets.
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TP53-regulating kinase243 records.
| Compound ID | Source ID | Source Type | Compound Name | Molecular Weight | Molecular Formula | Molecular Species | |
|---|---|---|---|---|---|---|---|
| B000923 | CHEMBL413 | Small molecule | SIROLIMUS | 914.19 | C51H79NO13 | NEUTRAL | Details |
| B012922 | CHEMBL274654 | Small molecule | ORANTINIB | 310.35 | C18H18N2O3 | ACID | Details |
| B013048 | CHEMBL535 | Small molecule | SUNITINIB | 398.48 | C22H27FN4O2 | BASE | Details |
| B014221 | CHEMBL14762 | Small molecule | SELICICLIB | 354.46 | C19H26N6O | NEUTRAL | Details |
| B014366 | CHEMBL428690 | Small molecule | ALVOCIDIB | 401.85 | C21H20ClNO5 | NEUTRAL | Details |
| B014785 | CHEMBL553 | Small molecule | ERLOTINIB | 393.44 | C22H23N3O4 | NEUTRAL | Details |
| B014805 | CHEMBL554 | Small molecule | LAPATINIB | 581.07 | C29H26ClFN4O4S | NEUTRAL | Details |
| B030847 | CHEMBL283120 | Small molecule | AXL-1717 | 414.41 | C22H22O8 | NEUTRAL | Details |
| B033576 | CHEMBL24828 | Small molecule | VANDETANIB | 475.36 | C22H24BrFN4O2 | BASE | Details |
| B035352 | CHEMBL281948 | Small molecule | K-252A | 467.48 | C27H21N3O5 | NEUTRAL | Details |
| B041764 | CHEMBL31965 | Small molecule | CANERTINIB | 485.95 | C24H25ClFN5O3 | NEUTRAL | Details |
| B050822 | CHEMBL38380 | Small molecule | FASUDIL | 291.38 | C14H17N3O2S | NEUTRAL | Details |
| B062111 | CHEMBL288441 | Small molecule | BOSUTINIB | 530.46 | C26H29Cl2N5O3 | NEUTRAL | Details |
| B071663 | CHEMBL296468 | Small molecule | BMS-387032 | 380.54 | C17H24N4O2S2 | BASE | Details |
| B083217 | CHEMBL300138 | Small molecule | ENZASTAURIN | 515.62 | C32H29N5O2 | NEUTRAL | Details |
| B088232 | CHEMBL939 | Small molecule | GEFITINIB | 446.91 | C22H24ClFN4O3 | NEUTRAL | Details |
| B088797 | CHEMBL941 | Small molecule | IMATINIB | 493.62 | C29H31N7O | NEUTRAL | Details |
| B144959 | CHEMBL91829 | Small molecule | RUBOXISTAURIN | 468.56 | C28H28N4O3 | BASE | Details |
| B165012 | CHEMBL101253 | Small molecule | VATALANIB | 346.82 | C20H15ClN4 | NEUTRAL | Details |
| B205165 | CHEMBL124660 | Small molecule | TANDUTINIB | 562.72 | C31H42N6O4 | BASE | Details |
| B276734 | CHEMBL1336 | Small molecule | SORAFENIB | 464.83 | C21H16ClF3N4O3 | NEUTRAL | Details |
| B299120 | CHEMBL180022 | Small molecule | NERATINIB | 557.05 | C30H29ClN6O3 | BASE | Details |
| B319858 | CHEMBL189963 | Small molecule | PALBOCICLIB | 447.54 | C24H29N7O2 | BASE | Details |
| B328891 | CHEMBL372764 | Small molecule | PERIFOSINE | 461.67 | C25H52NO4P | ACID | Details |
| B341327 | CHEMBL206834 | Small molecule | BAFETINIB | 576.63 | C30H31F3N8O | BASE | Details |
| B343041 | CHEMBL377300 | Small molecule | BRIVANIB | 370.38 | C19H19FN4O3 | NEUTRAL | Details |
| B361203 | CHEMBL384304 | Small molecule | RG-547 | 441.46 | C18H21F2N5O4S | NEUTRAL | Details |
| B361444 | CHEMBL217092 | Small molecule | SARACATINIB | 542.04 | C27H32ClN5O5 | NEUTRAL | Details |
| B361469 | CHEMBL1421 | Small molecule | DASATINIB | 488.02 | C22H26ClN7O2S | NEUTRAL | Details |
| B363083 | CHEMBL215152 | Small molecule | AZD-1152-HQPA | 507.57 | C26H30FN7O3 | BASE | Details |
| B363089 | CHEMBL415049 | Small molecule | BARASERTIB | 587.55 | C26H31FN7O6P | ZWITTERION | Details |
| B367860 | CHEMBL221959 | Small molecule | TOFACITINIB | 312.38 | C16H20N6O | NEUTRAL | Details |
| B371147 | CHEMBL223360 | Small molecule | LINIFANIB | 375.41 | C21H18FN5O | NEUTRAL | Details |
| B387990 | CHEMBL230011 | Small molecule | TG100-115 | 346.35 | C18H14N6O2 | NEUTRAL | Details |
| B416907 | CHEMBL400402 | Small molecule | 475.98 | C26H26ClN5O2 | BASE | Details | |
| B424611 | CHEMBL253969 | Small molecule | OSI-632 | 532.41 | C20H24BrF2N5O3S | BASE | Details |
| B426660 | CHEMBL255863 | Small molecule | NILOTINIB | 529.53 | C28H22F3N7O | NEUTRAL | Details |
| B428508 | CHEMBL259084 | Small molecule | MLN-8054 | 476.87 | C25H15ClF2N4O2 | ACID | Details |
| B431685 | CHEMBL405130 | Small molecule | WHI-P131 | 297.31 | C16H15N3O3 | NEUTRAL | Details |
| B436277 | CHEMBL572878 | Small molecule | TOZASERTIB | 464.6 | C23H28N8OS | NEUTRAL | Details |
| B436278 | CHEMBL402548 | Small molecule | DANUSERTIB | 474.57 | C26H30N6O3 | NEUTRAL | Details |
| B441029 | CHEMBL270995 | Small molecule | BRIVANIB ALANINATE | 441.46 | C22H24FN5O4 | NEUTRAL | Details |
| B441100 | CHEMBL411907 | Small molecule | SONOLISIB | 525.6 | C29H35NO8 | NEUTRAL | Details |
| B442167 | CHEMBL403989 | Small molecule | TG100-801 | 580.09 | C33H30ClN5O3 | BASE | Details |
| B452471 | CHEMBL462018 | Small molecule | TRICIRIBINE PHOSPHATE | 400.29 | C13H17N6O7P | ZWITTERION | Details |
| B452952 | CHEMBL488436 | Small molecule | AZD-5438 | 371.47 | C18H21N5O2S | NEUTRAL | Details |
| B453228 | CHEMBL507361 | Small molecule | MIRDAMETINIB | 482.2 | C16H14F3IN2O4 | NEUTRAL | Details |
| B455596 | CHEMBL460702 | Small molecule | BMS-777607 | 512.9 | C25H19ClF2N4O4 | NEUTRAL | Details |
| B456867 | CHEMBL491473 | Small molecule | CEDIRANIB | 450.51 | C25H27FN4O3 | BASE | Details |
| B460144 | CHEMBL475251 | Small molecule | R-406 | 470.46 | C22H23FN6O5 | NEUTRAL | Details |
| B469313 | CHEMBL494089 | Small molecule | GSK-690693 | 425.49 | C21H27N7O3 | BASE | Details |
| B470511 | CHEMBL521851 | Small molecule | PICTILISIB | 513.65 | C23H27N7O3S2 | NEUTRAL | Details |
| B486594 | CHEMBL496102 | Small molecule | AMG-208 | 383.41 | C22H17N5O2 | NEUTRAL | Details |
| B489525 | CHEMBL477772 | Small molecule | PAZOPANIB | 437.53 | C21H23N7O2S | NEUTRAL | Details |
| B490644 | CHEMBL513909 | Small molecule | BI-2536 | 521.67 | C28H39N7O3 | BASE | Details |
| B494066 | CHEMBL495727 | Small molecule | AT-9283 | 381.44 | C19H23N7O2 | NEUTRAL | Details |
| B494834 | CHEMBL522892 | Small molecule | DOVITINIB | 392.44 | C21H21FN6O | NEUTRAL | Details |
| B497877 | CHEMBL514201 | Small molecule | TALMAPIMOD | 513.01 | C27H30ClFN4O3 | NEUTRAL | Details |
| B508707 | CHEMBL483321 | Small molecule | CP-724714 | 469.55 | C27H27N5O3 | NEUTRAL | Details |
| B511261 | CHEMBL445813 | Small molecule | AT-7519 | 382.25 | C16H17Cl2N5O2 | BASE | Details |
| B520053 | CHEMBL483158 | Small molecule | ALISERTIB | 518.93 | C27H20ClFN4O4 | ACID | Details |
| B520055 | CHEMBL482767 | Small molecule | SNS-314 | 430.95 | C18H15ClN6OS2 | NEUTRAL | Details |
| B520120 | CHEMBL482967 | Small molecule | CYC-116 | 368.47 | C18H20N6OS | NEUTRAL | Details |
| B520121 | CHEMBL482968 | Small molecule | ENMD-2076 | 375.48 | C21H25N7 | NEUTRAL | Details |
| B522730 | CHEMBL502835 | Small molecule | NINTEDANIB | 539.64 | C31H33N5O4 | NEUTRAL | Details |
| B540975 | CHEMBL536151 | Small molecule | IMD-0354 | 383.68 | C15H8ClF6NO2 | NEUTRAL | Details |
| B559790 | CHEMBL564829 | Small molecule | MILCICLIB | 460.59 | C25H32N8O | NEUTRAL | Details |
| B562391 | CHEMBL551064 | Small molecule | AEW-541 | 425.54 | C26H27N5O | BASE | Details |
| B568337 | CHEMBL574737 | Small molecule | UCN-01 | 482.54 | C28H26N4O4 | BASE | Details |
| B568338 | CHEMBL572881 | Small molecule | MOTESANIB | 373.46 | C22H23N5O | NEUTRAL | Details |
| B568340 | CHEMBL558752 | Small molecule | RAF-265 | 518.42 | C24H16F6N6O | NEUTRAL | Details |
| B570962 | CHEMBL575448 | Small molecule | BMS-754807 | 461.51 | C23H24FN9O | NEUTRAL | Details |
| B573133 | CHEMBL576982 | Small molecule | QUIZARTINIB | 560.68 | C29H32N6O4S | NEUTRAL | Details |
| B574917 | CHEMBL571948 | Small molecule | Y-39983 | 280.33 | C16H16N4O | BASE | Details |
| B579824 | CHEMBL571546 | Small molecule | TIRBANIBULIN | 431.54 | C26H29N3O3 | NEUTRAL | Details |
| B582954 | CHEMBL565612 | Small molecule | SOTRASTAURIN | 438.49 | C25H22N6O2 | NEUTRAL | Details |
| B586744 | CHEMBL587723 | Small molecule | AEE-788 | 440.6 | C27H32N6 | NEUTRAL | Details |
| B596528 | CHEMBL592445 | Small molecule | GEDATOLISIB | 615.74 | C32H41N9O4 | BASE | Details |
| B597145 | CHEMBL603469 | Small molecule | LESTAURTINIB | 439.47 | C26H21N3O4 | NEUTRAL | Details |
| B602271 | CHEMBL601719 | Small molecule | CRIZOTINIB | 450.35 | C21H22Cl2FN5O | BASE | Details |
| B603809 | CHEMBL598797 | Small molecule | CUDC-101 | 434.5 | C24H26N4O4 | NEUTRAL | Details |
| B604615 | CHEMBL607707 | Small molecule | PELITINIB | 467.93 | C24H23ClFN5O2 | BASE | Details |
| B608601 | CHEMBL608533 | Small molecule | MIDOSTAURIN | 570.65 | C35H30N4O4 | NEUTRAL | Details |
| B616367 | CHEMBL1079175 | Small molecule | MK-2206 | 407.48 | C25H21N5O | BASE | Details |
| B617563 | CHEMBL1078178 | Small molecule | MOMELOTINIB | 414.47 | C23H22N6O2 | NEUTRAL | Details |
| B619385 | CHEMBL1090090 | Small molecule | VX-702 | 404.32 | C19H12F4N4O2 | NEUTRAL | Details |
| B619399 | CHEMBL1088751 | Small molecule | PH-797804 | 477.31 | C22H19BrF2N2O3 | NEUTRAL | Details |
| B619400 | CHEMBL1088752 | Small molecule | LOSMAPIMOD | 383.47 | C22H26FN3O2 | NEUTRAL | Details |
| B622556 | CHEMBL1090479 | Small molecule | GSK-1070916 | 507.64 | C30H33N7O | BASE | Details |
| B623658 | CHEMBL1091644 | Small molecule | LINSITINIB | 421.5 | C26H23N5O | NEUTRAL | Details |
| B625907 | CHEMBL1094408 | Small molecule | NMS-1286937 | 448.53 | C23H28N8O2 | NEUTRAL | Details |
| B630975 | CHEMBL1084546 | Small molecule | PF-00562271 | 507.5 | C21H20F3N7O3S | NEUTRAL | Details |
| B649637 | CHEMBL1171837 | Small molecule | PONATINIB | 532.57 | C29H27F3N6O | NEUTRAL | Details |
| B650126 | CHEMBL1173655 | Small molecule | AFATINIB | 485.95 | C24H25ClFN5O3 | BASE | Details |
| B675133 | CHEMBL1201182 | Small molecule | TEMSIROLIMUS | 1030.3 | C56H87NO16 | Details | |
| B691867 | CHEMBL1229517 | Small molecule | VEMURAFENIB | 489.93 | C23H18ClF2N3O3S | NEUTRAL | Details |
| B692515 | CHEMBL1230165 | Small molecule | SILMITASERTIB | 349.78 | C19H12ClN3O2 | ACID | Details |
| B692957 | CHEMBL1230607 | Small molecule | PHA-793887 | 361.49 | C19H31N5O2 | BASE | Details |
| B692959 | CHEMBL1230609 | Small molecule | FORETINIB | 632.66 | C34H34F2N4O6 | NEUTRAL | Details |
| B693474 | CHEMBL1231124 | Small molecule | AZD-1480 | 348.77 | C14H14ClFN8 | NEUTRAL | Details |